CID 146598741

Tert-butyl n-[3-(2-aminoethoxy)propyl]-n-methylcarbamate

Structural Information

Molecular Formula
C11H24N2O3
SMILES
CC(C)(C)OC(=O)N(C)CCCOCCN
InChI
InChI=1S/C11H24N2O3/c1-11(2,3)16-10(14)13(4)7-5-8-15-9-6-12/h5-9,12H2,1-4H3
InChIKey
HJNQSXHWAYUCTI-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(2-aminoethoxy)propyl]-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

232.1787 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.18598 156.6
[M+Na]+ 255.16792 162.5
[M+NH4]+ 250.21252 161.8
[M+K]+ 271.14186 159.4
[M-H]- 231.17142 154.9
[M+Na-2H]- 253.15337 157.5
[M]+ 232.17815 156.4
[M]- 232.17925 156.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe